Basic information
- CAS
18602-17-0- Standard SMILES
CCCCCCCCCCCCOCC(O)C[N+](C)(CCO)CCO.COS(=O)(=O)[O-]- InChIKey
PHLIZCDUCLCAEQ-UHFFFAOYSA-M- Molecular formula
- C21H47NO8S
- Average molar mass
- 473.7 g/mol
- Monoisotopic mass
- 473.30223863
Names & identifiers
- Preferred name
- 1-Propanaminium, 3-(dodecyloxy)-2-hydroxy-N,N-bis(2-hydroxyethyl)-N-methyl-, methyl sulfate (1:1)
- IUPAC
- (3-dodecoxy-2-hydroxypropyl)-bis(2-hydroxyethyl)-methylazanium;methyl sulfate
- English name
- [3-(dodecyloxy)-2-hydroxypropyl]bis(2-hydroxyethyl)methylammonium methyl sulphate
- Molecular formula
- C21H47NO8S
- Molecular weight
- 473.66478
Names & synonyms
18602-17-0EINECS 242-443-4DTXSID608850571-Propanaminium, 3-(dodecyloxy)-2-hydroxy-N,N-bis(2-hydroxyethyl)-N-methyl-, methyl sulfate (salt)1-Propanaminium, 3-(dodecyloxy)-2-hydroxy-N,N-bis(2-hydroxyethyl)-N-methyl-, methyl sulfate (1:1)RefChem:77083DTXCID001024463(3-(Dodecyloxy)-2-hydroxypropyl)bis(2-hydroxyethyl)methylammonium methyl sulphate[3-(dodecyloxy)-2-hydroxypropyl]bis(2-hydroxyethyl)methylammonium methyl sulphate(3-dodecoxy-2-hydroxypropyl)-bis(2-hydroxyethyl)-methylazanium;methyl sulfatePHLIZCDUCLCAEQ-UHFFFAOYSA-MSCHEMBL1485545
Show more names
Cyastat 609FELICIS-2601Antistatic agent 6093-(Dodecyloxy)-2-hydroxypropyl]bis(2-hydroxyethyl)methylammonium methylsulfat3-(Dodecyloxy)-2-hydroxy-N,N-bis-(2-hydroxyethyl)-N-methyl-1-propanaminium methyl sulfate1-Propanaminium, 3-(dodecyloxy)-2-hydroxy-N,N-bis (2-hydroxyethyl)-N-methyl-, methyl sulfate
Properties
Computed structural properties
- Topological polar surface area
- 145 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 19
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 361
Experimental & physicochemical properties
Physical DescriptionLiquid
Physicochemical properties
- Melting point
- 59 · 59-60 °C
- EPA Substance Registry System
- 1 · 1-Propanaminium, 3-(dodecyloxy)-2-hydroxy-N,N-bis(2-hydroxyethyl)-N-methyl-, methyl sulfate (salt) (18602-17-0)
- Symbol(GHS)
- 7 · GHS07,GHS09,GHS05
- Signal word
- Danger
- Hazard statements
- 410 · H410-H400-H312-H318-H314
- Precautionary statements
- 280 · P280-P302+P352-P312-P322-P363-P501-P273-P391-P501-P273-P391-P501-P280-P305+P351+P338-P310-P260-P264-P280-P301+P330+P331-P303+P361+P353-P363-P304+P340-P310-P321-P305+P351+P338-P405-P501
- TSCA
- TSCA listed
Safety & regulation
GHS classification
GHS Classification
Danger
H312 (100%): Harmful in contact with skin [Warning Acute toxicity, dermal]
P260, P264, P264+P265, P273, P280, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P354+P338, P316, P317, P321, P362+P364, P363, P391, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 14 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Regulatory Information
1-Propanaminium, 3-(dodecyloxy)-2-hydroxy-N,N-bis(2-hydroxyethyl)-N-methyl-, methyl sulfate (1:1) is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of 1-Propanaminium, 3-(dodecyloxy)-2-hydroxy-N,N-bis(2-hydroxyethyl)-N-methyl-, methyl sulfate (1:1) are required to report information about their production and use of this chemical to the EPA under the Toxic Substances Control Act (TSCA). (40 eCFR Part 711)
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Safety data
- tsca
- TSCA listed
- Signal word
- Danger
- Symbol(GHS)
- GHS07,GHS09,GHS05
- Hazard statements
- H410-H400-H312-H318-H314
- Precautionary statements
- P280-P302+P352-P312-P322-P363-P501-P273-P391-P501-P273-P391-P501-P280-P305+P351+P338-P310-P260-P264-P280-P301+P330+P331-P303+P361+P353-P363-P304+P340-P310-P321-P305+P351+P338-P405-P501
Chemistry & industry
Uses & manufacturing
U.S. Production2023: <50,000 lb
Industry UsesAnti-static agent
Household ProductsInformation on 4 consumer products that contain 1-Propanaminium, 3-(dodecyloxy)-2-hydroxy-N,N-bis(2-hydroxyethyl)-N-methyl-, methyl sulfate (salt) in the following categories is provided:
General Manufacturing Information
Computer and Electronic Product Manufacturing
1-Propanaminium, 3-(dodecyloxy)-2-hydroxy-N,N-bis(2-hydroxyethyl)-N-methyl-, methyl sulfate (1:1): ACTIVE
Suppliers5 total
陕西缔都新材料有限公司029-63373950 17392216152 · [email protected]
上海遐瑞医药科技有限公司+86-021-61551413 · [email protected]
Shanghai Scibiotron Pharmaceutical Co., Ltd+86-16621589600 · [email protected]
河南天孚化工有限公司+86-0371-55170693 +86-19937530512 · [email protected]
中梦研（湖北）科技有限公司18062399888; 18062399888 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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